Chemical ID: 4684842

CCC(=O)C(C)CC=CCCC(C)C
Chemical ID:
4684842
Name [?]:
4,10-dimethylundec-6-en-3-one
SMILES [?]:
CCC(=O)C(C)CC=CCCC(C)C
InChi [?]:
InChI=1/C13H24O/c1-5-13(14)12(4)10-8-6-7-9-11(2)3/h6,8,11-12H,5,7,9-10H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,13,14,6,2,9,10,8,11,7,12,5,3,4/E:(2,3)/rA:14cCCCOCCCCCCCCCC/rB:s1;s2;d3;s3;s5;s5;s7;w8;s9;s10;s11;s12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H24O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:9.19575
Area:430.382
Solvation:-1.56379
Coulombic:-10.0423
Bond Count [?]
All:13
Single:11
Double:2
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:196.329
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.39
LogP (Chemaxon):4.65

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Descriptor Annotations

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